- InChI
- InChI=1S/C15H21F2NO/c1-3-4-5-6-7-11(2)18-15(19)12-8-9-13(16)14(17)10-12/h8-11H,3-7H2,1-2H3,(H,18,19)
- InChI Key
- DHDAQNQJOQZWCB-UHFFFAOYSA-N
- Formula
- C15H21F2NO
- SMILES
- CCCCCCC(C)NC(=O)c1ccc(F)c(F)c1
- Molecular Weight1
- 269.33
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.7264 | Relay (... Calculated Property | |
| ΔfG° | -263.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -626.36 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 37.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.29 | kJ/mol | Relay (... Calculated Property |
| IE | 8.79 | eV | Relay (... Calculated Property |
| log10WS | -5.16 | Relay (... Calculated Property | |
| logPoct/wat | 4.054 | Crippen Calculated Property | |
| McVol | 213.540 | ml/mol | McGowan Calculated Property |
| Pc | 1790.91 | kPa | Joback Calculated Property |
| Inp | [1913.00; 1913.00] |
|
|
| Inp | 1913.00 | NIST | |
| Inp | 1913.00 | NIST | |
| Tboil | 573.30 | K | Relay (... Calculated Property |
| Tc | 787.18 | K | Relay (... Calculated Property |
| Tfus | 318.95 | K | Relay (... Calculated Property |
| Vc | 0.780 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [590.73; 670.07] | J/mol×K | [681.38; 871.18] |
|
| Cp,gas | 590.73 | J/mol×K | 681.38 | Joback Calculated Property |
| Cp,gas | 605.97 | J/mol×K | 713.01 | Joback Calculated Property |
| Cp,gas | 620.37 | J/mol×K | 744.65 | Joback Calculated Property |
| Cp,gas | 633.95 | J/mol×K | 776.28 | Joback Calculated Property |
| Cp,gas | 646.73 | J/mol×K | 807.91 | Joback Calculated Property |
| Cp,gas | 658.77 | J/mol×K | 839.55 | Joback Calculated Property |
| Cp,gas | 670.07 | J/mol×K | 871.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,4-Difluorobenzamide, N-(2-octyl)-.
Sources
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